化学式

CAS号

IUPAC Name

(2R,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-[(2R,5S)-5-[(2R,3S,5R)-5-[(5S,6R,8S,9S)-6,8-二甲基-2-氧代-1,3,10-trioxaspiro[4.5]癸烷-9-基]-3-methyloxolan-2-基]-5-ethyloxolan-2-基]-7-羟基-2,8-二甲基-1,10-二噁螺[4.5]癸烷-9-基]-3-甲氧基-2-甲基戊酸 (2R,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-[(2R,5S)-5-[(2R,3S,5R)-5-[(5S,6R,8S,9S)-6,8-dimethyl-2-oxo-1,3,10-trioxaspiro[4.5]decan-9-yl]-3-methyloxolan-2-yl]-5-ethyloxolan-2-yl]-7-hydroxy-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-3-methoxy-2-methylpentanoic acid

InChI

InChI=1S/C37H60O12/c1-10-35(31-20(3)16-26(44-31)28-19(2)15-21(4)37(47-28)18-43-33(41)48-37)12-11-27(45-35)34(8)13-14-36(49-34)17-25(38)22(5)30(46-36)23(6)29(42-9)24(7)32(39)40/h19-31,38H,10-18H2,1-9H3,(H,39,40)/t19-,20-,21+,22+,23-,24+,25-,26+,27+,28-,29+,30-,31+,34-,35-,36+,37+/m0/s1

InChI Key

HTXDYTLCBSNIQH-PZCWNUEYSA-N

Canonical SMILES

CCC1(CCC(O1)C2(CCC3(O2)CC(C(C(O3)C(C)C(C(C)C(=O)O)OC)C)O)C)C4C(CC(O4)C5C(CC(C6(O5)COC(=O)O6)C)C)C

别名

• CHEMBL4531746